Re: AMBER: Problem in running CARNAL

From: Bill Ross <>
Date: Thu, 6 Dec 2007 11:37:07 -0800 (PST)

> HBOND: file already exists

> I don't understand why it is not completing the whole calculation?

Probably an output file already exists - if you remove it,
things should work if your input is good (can't read it because your
mail is not simple ascii format).

Carnal is not supported anymore, so you may want to switch to ptraj.

The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Sun Dec 09 2007 - 06:07:29 PST
Custom Search